6030-1660 Screening compound: tert-butyl 2-[({[1-ethoxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl}methyl)carbamoyl]pyrrolidine-1-carboxylate

6030-1660 Screening compound: tert-butyl 2-[({[1-ethoxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl}methyl)carbamoyl]pyrrolidine-1-carboxylate
6030-1660 Screening compound: tert-butyl 2-[({[1-ethoxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl}methyl)carbamoyl]pyrrolidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 6030-1660
tert-butyl 2-[({[1-ethoxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl}methyl)carbamoyl]pyrrolidine-1-carboxylate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

6030-1660

Molecular Formula

C23H33N3O7 (C23 H33 N3 O7)

Compound Name

tert-butyl 2-[({[1-ethoxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl}methyl)carbamoyl]pyrrolidine-1-carboxylate

IUPAC name

tert-butyl 2-[({[1-ethoxy-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoyl}methyl)carbamoyl]pyrrolidine-1-carboxylate

SMILES

CCOC(C(Cc(cc1)ccc1O)NC(CNC(C(CCC1)N1C(OC(C)(C)C)=O)=O)=O)=O

InChI

InChI=1S/C23H33N3O7/c1-5-32-21(30)17(13-15-8-10-16(27)11-9-15)25-19(28)14-24-20(29)18-7-6-12-26(18)22(31)33-23(2,3)4/h8-11,17-18,27H,5-7,12-14H2,1-4H3,(H,24,29)(H,25,28)

InChI Key

YOJKVKMGVAUHIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14711136

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.53

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

14.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

2.026

Distribution Coefficient, logD

2.025

Water Solubility, LogSw

-2.46

Polar Surface Area

109.266

Acid Dissociation Constant (pKa)

10.14

Base Dissociation Constant (pKb)

-0.96

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

56.50

6030-1660 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Carbonic Anhydrase II Library (4939 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 6030-1660 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6030-1660?
Check Price and Availability of 6030-1660, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 6030-1660 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6030-1660
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6030-1660
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 6030-1660 available by request